2-(2,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-(2,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
2-(2,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one
Compound characteristics
| Compound ID: | C202-3522 |
| Compound Name: | 2-(2,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-2,3,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-4(1H)-one |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C27 H30 N2 O5 S |
| Smiles: | COc1ccc(C2NC(c3c4CCCCc4sc3N2Cc2ccc(c(c2)OC)OC)=O)c(c1)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7601 |
| logD: | 4.7601 |
| logSw: | -4.7363 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.888 |
| InChI Key: | MMMZJICBRBGQBU-VWLOTQADSA-N |